4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one

Systemtic Name: 4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one Openeye Name: 4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one CAS Name: 4-(4-chloro-5-methyl-3-nitro-1-pyrazolyl)-1-(3,4-dihydro-2H-quinolin-1-yl)-1-butanone IUPAC Name: 4-(4-chloro-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one Traditional Name: 4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one Formula: C17H19ClN4O3 MolecularWeight: 362.81076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)N2CCCC3=CC=CC=C32)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)N2CCCC3=CC=CC=C32)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H19ClN4O3/c1-12-16(18)17(22(24)25)19-21(12)11-5-9-15(23)20-10-4-7-13-6-2-3-8-14(13)20/h2-3,6,8H,4-5,7,9-11H2,1H3